N-(2H-1,3-benzodioxol-5-yl)-N'-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-N'-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea
N-(2H-1,3-benzodioxol-5-yl)-N'-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea
Compound characteristics
| Compound ID: | D577-0292 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-N'-(4-{[2-(cyclohexylamino)-6-methylpyrimidin-4-yl]amino}phenyl)urea |
| Molecular Weight: | 460.54 |
| Molecular Formula: | C25 H28 N6 O3 |
| Smiles: | Cc1cc(Nc2ccc(cc2)NC(Nc2ccc3c(c2)OCO3)=O)nc(NC2CCCCC2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.0539 |
| logD: | 5.8185 |
| logSw: | -5.3647 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 88.608 |
| InChI Key: | WYRNBTJBNGMPKH-UHFFFAOYSA-N |